CID 6004359

20432-36-4

Structural Information

Molecular Formula

C₁₃H₁₅NO

SMILES

CN(C)C1=CC=C(C=C1)/C=C/C=C/C=O

InChI

InChI=1S/C13H15NO/c1-14(2)13-9-7-12(8-10-13)6-4-3-5-11-15/h3-11H,1-2H3/b5-3+,6-4+

InChIKey

JYHAOJGBXVCDOC-GGWOSOGESA-N

Compound name

(2E,4E)-5-[4-(dimethylamino)phenyl]penta-2,4-dienal

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 287
Patents: 201.11537 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	202.12265	147.1
[M+Na]+	224.10459	159.3
[M+NH4]+	219.14919	155.1
[M+K]+	240.07853	151.6
[M-H]-	200.10809	149.8
[M+Na-2H]-	222.09004	153.8
[M]+	201.11482	149.5
[M]-	201.11592	149.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe